Home Carboxys 2,2,2-trifluoroethyl piperidine-1-carboxylate

2,2,2-trifluoroethyl piperidine-1-carboxylate

CAS No.:
1092074-32-2
Catalog Number:
AG01A8CK
Molecular Formula:
C8H12F3NO2
Molecular Weight:
211.1816
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Product Description
Catalog Number:
AG01A8CK
Chemical Name:
2,2,2-trifluoroethyl piperidine-1-carboxylate
CAS Number:
1092074-32-2
Molecular Formula:
C8H12F3NO2
Molecular Weight:
211.1816
MDL Number:
MFCD15209700
IUPAC Name:
2,2,2-trifluoroethyl piperidine-1-carboxylate
InChI:
InChI=1S/C8H12F3NO2/c9-8(10,11)6-14-7(13)12-4-2-1-3-5-12/h1-6H2
InChI Key:
VWSSKHWULVBDEU-UHFFFAOYSA-N
SMILES:
O=C(N1CCCCC1)OCC(F)(F)F
Properties
Complexity:
199  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
211.082g/mol
Formal Charge:
0
Heavy Atom Count:
14  
Hydrogen Bond Acceptor Count:
5  
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
211.184g/mol
Monoisotopic Mass:
211.082g/mol
Rotatable Bond Count:
2  
Topological Polar Surface Area:
29.5A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
2.1  
Properties